CID 12024988

2-[(2-bromophenyl)methyl]pyrrolidine

Structural Information

Molecular Formula
C11H14BrN
SMILES
C1CC(NC1)CC2=CC=CC=C2Br
InChI
InChI=1S/C11H14BrN/c12-11-6-2-1-4-9(11)8-10-5-3-7-13-10/h1-2,4,6,10,13H,3,5,7-8H2
InChIKey
AZQJWMRIFFFWIU-UHFFFAOYSA-N
Compound name
2-[(2-bromophenyl)methyl]pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.03096 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.03824 151.8
[M+Na]+ 262.02018 154.5
[M+NH4]+ 257.06478 157.3
[M+K]+ 277.99412 154.6
[M-H]- 238.02368 153.5
[M+Na-2H]- 260.00563 155.3
[M]+ 239.03041 151.4
[M]- 239.03151 151.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No patent data available for this compound.